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(2S,2aR,4aS,7aR,7bS)-6-(t-Butyldimethylsilyloxy)-5-[(3E)-4,8-Dimethyl-2-(4-methylphenyl)sulfonyl-3,7-nonadienyl]-2-methoxy-2a,3,4,4a,5,6,a,7b-octahydro-2H-1,7-dioxacyclopenta[c,d]indene
SpectraBase Compound ID A9QjS67Uv9F
InChI InChI=1S/C34H54O6SSi/c1-22(2)12-11-13-24(4)20-26(41(35,36)25-16-14-23(3)15-17-25)21-29-27-18-19-28-30(27)33(38-31(28)37-8)39-32(29)40-42(9,10)34(5,6)7/h12,14-17,20,26-33H,11,13,18-19,21H2,1-10H3/b24-20+/t26?,27-,28-,29?,30+,31-,32?,33+/m1/s1
InChIKey IROONRQFUNKOJL-JVMDUACLSA-N
Mol Weight 618.9 g/mol
Molecular Formula C34H54O6SSi
Exact Mass 618.341037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2JxyT2y5CaX
Name (2S,2aR,4aS,7aR,7bS)-6-(t-Butyldimethylsilyloxy)-5-[(3E)-4,8-Dimethyl-2-(4-methylphenyl)sulfonyl-3,7-nonadienyl]-2-methoxy-2a,3,4,4a,5,6,a,7b-octahydro-2H-1,7-dioxacyclopenta[c,d]indene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H54O6SSi
InChI InChI=1S/C34H54O6SSi/c1-22(2)12-11-13-24(4)20-26(41(35,36)25-16-14-23(3)15-17-25)21-29-27-18-19-28-30(27)33(38-31(28)37-8)39-32(29)40-42(9,10)34(5,6)7/h12,14-17,20,26-33H,11,13,18-19,21H2,1-10H3/b24-20+/t26?,27-,28-,29?,30+,31-,32?,33+/m1/s1
InChIKey IROONRQFUNKOJL-JVMDUACLSA-N
Molecular Weight 618.945 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(CC1C(O[C@]2([C@]3([C@@]1(CC[C@]3([C@](OC)(O2)[H])[H])[H])[H])[H])O[Si](C(C)(C)C)(C)C)\C=C\(CCC=C(C)C)C
SPLASH splash10-014i-9232100000-598a910ea6040700306f
Source of Spectrum F-49-10571-24
Wiley ID 788960